General Property |
Molceule ID (DB) | EGIN0003761 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 35 compound |
IUPAC Name | 6-(2,6-dichlorophenyl)-8-methyl-2-[(pyridin-3-ylmethyl)amino]-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
Formula | C20H15Cl2N5O |
Mass | 412.272 |
Exact Mass | 411.0653655 |
Composition | C (58.27%), H (3.67%), Cl (17.2%), N (16.99%), O (3.88%) |
Atom Count | 43 |
PI | 9.64 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)NCc1cnccc1)C |
InChI | 1S/C20H15Cl2N5O/c1-27-18-13(8-14(19(27)28)17-15(21)5-2-6-16(17)22)11-25-20(26-18)24-10-12-4-3-7-23-9
-12/h2-9,11H,10H2,1H3,(H,24,25,26) |
InChIKey | XHGSDPKRXJOFGF-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 9703473 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | FGFr | c-Src | PDGFr | ALL |
Pub Chem Link |
5327882
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Drug Bank Link | - |
ChemSpider Link | 4485052 |
ChEMBL Link | CHEMBL110034 |